Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.37 |
| ▸ | TOP2A | P11388 | 1/20 | 0.33 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21398145 | 0.88 | GABRG2 (0.40) | GABRG2GABRB3GABRA5TOP2ATOP2B | |
| SCHEMBL15674426 | 0.82 | BACE1 (0.33) | IDO1CTSDBACE1HTR2BSIGMAR1 | |
| SCHEMBL17867637 | 0.78 | PDK2 (0.33) | TOP2ATOP2BIDO1GSK3ACDK9 | |
| SCHEMBL21398146 | 0.77 | GABRG2 (0.39) | GABRG2GABRB3GABRA5CLK4KMT2A | |
| SCHEMBL30658990 | 0.77 | GABRG2 (0.39) | GABRG2GABRB3GABRA5CLK4KMT2A | |
| SCHEMBL2515713 | 0.76 | PDK2 (0.43) | GSK3ACDK5CTSDBACE1KMT2A | |
| SCHEMBL29403081 | 0.75 | PDK2 (0.44) | HTR2BSIGMAR1TDP2CA1CA2 | |
| SCHEMBL204806 | 0.75 | PDK2 (0.44) | HTR2BSIGMAR1TDP2CA1CA2 | |
| SCHEMBL29587737 | 0.75 | PDK2 (0.44) | HTR2BSIGMAR1TDP2CA1CA2 | |
| SCHEMBL15674721 | 0.72 | PDK2 (0.36) | CDK5TAOK1CLK4KMT2APDE4B |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019179497-A1 | ORGANIC COMPOUND WITH PYRIDINE AS CORE AND USE THEREOF | 江苏三月光电科技有限公司 | 2019-09-26 | — | — | WO | disclosed |